(2-bromanyl-6-ethoxy-4-methanoyl-phenyl) 3-nitrobenzoate

Systemtic Name: (2-bromanyl-6-ethoxy-4-methanoyl-phenyl) 3-nitrobenzoate Openeye Name: (2-bromo-6-ethoxy-4-formyl-phenyl) 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid (2-bromo-6-ethoxy-4-formylphenyl) ester IUPAC Name: (2-bromo-6-ethoxy-4-formylphenyl) 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (2-bromo-6-ethoxy-4-formyl-phenyl) ester Formula: C16H12BrNO6 MolecularWeight: 394.17358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=O)Br)OC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=O)Br)OC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H12BrNO6/c1-2-23-14-7-10(9-19)6-13(17)15(14)24-16(20)11-4-3-5-12(8-11)18(21)22/h3-9H,2H2,1H3